Geometry & MOs

Info

ID:	69575
PubChem CID:	47193872
Reduced:	ON4C14H14 (1)
Stoich.:	AB4C14D14 (1)
Weight, g/mol:	387.08076
ΔH_f, kcal/mol:	51.13
Dipole, Da:	4.29
IP(EA), eV:	-8.62(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-iodophenyl)-3-[2-(4-methylpiperidin-1-yl)ethyl]urea

Drug info:

PubChemData

Smile

CNC(=O)NC1=CC=C(C=C1)N=NC2=CC=CC=C2

DOS

IR

Vibrations